| SpectraBase Spectrum ID |
3iBApF8Zbk |
| Name |
2-n-dodecylthioorotic acid hydrobromide |
| Alternate Name(s) |
2-(dodecylsulfanyl)-6-oxo-1,6-dihydro-4-pyrimidinecarboxylic acid hydrobromide
6-Carboxy-2-dodecylsulfanyl-4-oxo-3,4-dihydro-pyrimidin-1-ium; bromide |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C17H29BrN2O3S |
| InChI |
InChI=1S/C17H28N2O3S.BrH/c1-2-3-4-5-6-7-8-9-10-11-12-23-17-18-14(16(21)22)13-15(20)19-17;/h13H,2-12H2,1H3,(H,21,22)(H,18,19,20);1H |
| InChIKey |
JZDQYACGLHCQGK-UHFFFAOYSA-N |
| Molecular Weight |
421.394 g/mol |
| SMILES |
[Br-].[NH+]1=C(NC(C=C1C(=O)O)=O)SCCCCCCCCCCCC |
| SPLASH |
splash10-01ox-0079400000-a85886fe6078412c6de5 |
| Source of Spectrum |
O-29-50-0 |
| Wiley ID |
1377775 |
